CID 4162

Methyprylon

Structural Information

Molecular Formula
C10H17NO2
SMILES
CCC1(C(=O)C(CNC1=O)C)CC
InChI
InChI=1S/C10H17NO2/c1-4-10(5-2)8(12)7(3)6-11-9(10)13/h7H,4-6H2,1-3H3,(H,11,13)
InChIKey
SIDLZWOQUZRBRU-UHFFFAOYSA-N
Compound name
3,3-diethyl-5-methylpiperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

52
References

4385
Patents

183.12593 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.13321 142.3
[M+Na]+ 206.11515 152.9
[M+NH4]+ 201.15975 150.7
[M+K]+ 222.08909 145.5
[M-H]- 182.11865 142.4
[M+Na-2H]- 204.10060 146.8
[M]+ 183.12538 143.7
[M]- 183.12648 143.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe